SCHEMBL4812271

SCHEMBL4812271

N#CCCCOC(C(=O)NCc1ccccc1)C(O)[CH]Cc1cc(F)cc(F)c1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 5/20 0.35
SCN9A Q15858 5/20 0.35
PADI4 Q9UM07 1/20 0.33
CTSD P07339 3/20 0.32
CYP2D6 P10635 1/20 0.32
MCL1 Q07820 1/20 0.31
BACE1 P56817 2/20 0.31
CARM1 Q86X55 1/20 0.31
PRMT6 Q96LA8 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4812286 0.74 SCN9A (0.37) SCN5ASCN9ACTSDCYP2D6MCL1
SCHEMBL4814117 0.64 NPC1 (0.35)
SCHEMBL4811289 0.62 SCN9A (0.38) SCN5ASCN9ACTSDCYP2D6BACE1
SCHEMBL6567682 0.60 SCN5A (0.43) SCN5ASCN9ABACE1
SCHEMBL4817379 0.60 LMNA (0.40) CTSDCYP2D6BACE1
SCHEMBL10431135 0.57 MCL1 (0.57) SCN9ACYP2D6MCL1
SCHEMBL3139954 0.57 F2 (0.42)
SCHEMBL10934425 0.57 MCL1 (0.51) SCN9ACYP2D6MCL1
SCHEMBL11192421 0.56 KMT2A (0.53) SCN9ACYP2D6
SCHEMBL10988016 0.55 MEN1 (0.49) SCN9AMCL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US claimed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US claimed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US claimed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 US claimed
US-7358264-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY (US) 2008-04-15 US disclosed
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US disclosed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US disclosed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US disclosed
US-6864290-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN, LLP (US) 2005-03-08 US disclosed
EP-1404328-A1 ALPHA-HYDROXYAMIDE STATINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-04-07 EP disclosed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 US disclosed
WO-2003006021-A1 ALPHA-HYDROXYAMIDE STATINE DERIVATIVES FOR THE TREATMENT OF ALZH EIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2003-01-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN5A 1457/4885SCN9A 2355/4885PADI4 3793/4885
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN5A 1457/4885SCN9A 2355/4885PADI4 3793/4885
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN5A 1443/4885SCN9A 2386/4885PADI4 3835/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.